4-[[4-[(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[(9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(9-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[(9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[(4-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl]piperazino]methyl]benzonitrile Formula: C22H23N5O MolecularWeight: 373.45092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=CC2=O)CN3CCN(CC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC=CN2C1=NC(=CC2=O)CN3CCN(CC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H23N5O/c1-17-3-2-8-27-21(28)13-20(24-22(17)27)16-26-11-9-25(10-12-26)15-19-6-4-18(14-23)5-7-19/h2-8,13H,9-12,15-16H2,1H3